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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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230495 87571083 1 ISN2O4C14H15 ABC2D4E14F15 -131.59 3.38 -8.84 -1.8 0
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230496 87571087 1 Cl2N3O3C16H17 A2B3C3D16E17 -12.27 6.61 -9.73 -1.69 0
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230497 87571088 1 Cl2N3O3C16H17 A2B3C3D16E17 -9.73 8.61 -9.65 -1.62 0
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230498 87571092 1 O6C23H44 A6B23C44 -338.13 7.02 -9.65 0.09 0
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230499 87571093 1 O6C23H42 A6B23C42 -318.97 5.51 -9.61 -0.45 0
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230500 87571104 1 ClSO2N5C27H34 ABC2D5E27F34 -6.48 4.63 -8.84 -0.75 0
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230501 87571106 2 O3C11H12 A3B11C12 -239.71 1.51 -8.42 -0.2 0
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230502 87571118 1 BSO2N3F5C27H47 ABC2D3E5F27G47 -427.47 14.17 -11.0 -2.76 0
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230503 87571129 1 ClF2S2N4O6H15C22 AB2C2D4E6F15G22 -196.28 8.94 -9.59 -1.46 1
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230504 87571135 1 N2C11H21 A2B11C21 -0.34 2.38 0.0 0.0 0
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230505 87571145 1 FNOC14H20 ABCD14E20 -71.08 2.16 -9.04 -0.12 0
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230506 87571149 1 F2S2N4O7C27H28 A2B2C4D7E27F28 -293.84 9.21 -8.35 -1.17 0
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230507 87571150 1 ClF2S2N3O6H22C24 AB2C2D3E6F22G24 -260.1 9.34 -9.31 -1.58 0
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230508 87571151 1 PSO4C9H17 ABC4D9E17 -153.38 0.7 -8.84 -1.1 0
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230509 87571157 1 O9C72H118 A9B72C118 -505.78 4.8 -9.19 0.03 0
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230510 87571158 1 S2N3O7C27H29 A2B3C7D27E29 -181.47 5.63 -9.12 -1.13 0
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230511 87571159 1 FCl2N2S2O6H17C22 AB2C2D2E6F17G22 -192.91 8.54 -9.17 -1.47 0
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230512 87571162 1 N2O5C14H24 A2B5C14D24 -225.37 4.07 -10.28 -0.51 0
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230513 87571164 1 N2O5C14H22 A2B5C14D22 -214.26 3.27 -10.31 -0.25 0
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230514 87571165 1 O4C7H16 A4B7C16 -202.24 2.31 -10.12 1.48 0
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230515 87571196 1 Si2O3C11H23 A2B3C11D23 -181.77 2.28 0.0 0.0 0
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230516 87571197 1 Si2O3C11H23 A2B3C11D23 -86.84 2.51 0.0 0.0 0
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230517 87571201 2 NOC6H7 ABC6D7 -35.07 6.67 -10.5 -0.86 0
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230518 87571209 1 ClNS2O6C12H14 ABC2D6E12F14 -197.59 4.41 -9.61 -0.79 0
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230519 87571210 1 NO5C25H47 AB5C25D47 -323.98 4.18 -10.19 0.1 0